cyclopentyl-methyl-[3-[[(3S)-6-oxidanylidene-1-(2-pyridin-2-ylethyl)piperidin-3-yl]carbonylamino]propyl]azanium

Systemtic Name: cyclopentyl-methyl-[3-[[(3S)-6-oxidanylidene-1-(2-pyridin-2-ylethyl)piperidin-3-yl]carbonylamino]propyl]azanium Openeye Name: cyclopentyl-methyl-[3-[[(3S)-6-oxo-1-[2-(2-pyridyl)ethyl]piperidine-3-carbonyl]amino]propyl]ammonium CAS Name: cyclopentyl-methyl-[3-[[oxo-[(3S)-6-oxo-1-[2-(2-pyridinyl)ethyl]-3-piperidinyl]methyl]amino]propyl]ammonium IUPAC Name: cyclopentyl-methyl-[3-[[(3S)-6-oxo-1-(2-pyridin-2-ylethyl)piperidine-3-carbonyl]amino]propyl]azanium Traditional Name: cyclopentyl-[3-[[(3S)-6-keto-1-[2-(2-pyridyl)ethyl]nipecotoyl]amino]propyl]-methyl-ammonium Formula: C22H35N4O2+ MolecularWeight: 387.5389

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCCNC(=O)C1CCC(=O)N(C1)CCC2=CC=CC=N2)C3CCCC3

Isomeric SMILES

C[NH+](CCCNC(=O)[C@H]1CCC(=O)N(C1)CCC2=CC=CC=N2)C3CCCC3

InChI

InChI=1S/C22H34N4O2/c1-25(20-8-2-3-9-20)15-6-14-24-22(28)18-10-11-21(27)26(17-18)16-12-19-7-4-5-13-23-19/h4-5,7,13,18,20H,2-3,6,8-12,14-17H2,1H3,(H,24,28)/p+1/t18-/m0/s1